General Information of the Compound
| Compound ID |
CP0866738
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| Compound Name |
5-[2-Chloro-5-(trifluoromethyl)phenyl]-6-(cyclopropylmethoxy)-N-[(1R,2R)-2-hydroxycyclohexyl]-3-pyridinecarboxamide
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| Structure |
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| Formula |
C23H24ClF3N2O3
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| Molecular Weight |
468.903
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| Canonical SMILES |
O=C(N[C@@H]1CCCC[C@H]1O)c1cnc(OCC2CC2)c(-c2cc(C(F)(F)F)ccc2Cl)c1
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| InChI |
InChI=1S/C23H24ClF3N2O3/c24-18-8-7-15(23(25,26)27)10-16(18)17-9-14(11-28-22(17)32-12-13-5-6-13)21(31)29-19-3-1-2-4-20(19)30/h7-11,13,19-20,30H,1-6,12H2,(H,29,31)/t19-,20-/m1/s1
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| InChIKey |
NAWPDVZPFVQQOC-WOJBJXKFSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2